![Ethanone, 1-(4-tert-butylphenyl)-2-[(3-nitrophenyl)amino]-](/api/spectrum/GThouauJOmL/structure.png?h=300&w=458 "Ethanone, 1-(4-tert-butylphenyl)-2-[(3-nitrophenyl)amino]-")
| SpectraBase Compound ID | CpQA7hzwxKF |
|---|---|
| InChI | InChI=1S/C18H20N2O3/c1-18(2,3)14-9-7-13(8-10-14)17(21)12-19-15-5-4-6-16(11-15)20(22)23/h4-11,19H,12H2,1-3H3 |
| InChIKey | GESRODRBJLFNSW-UHFFFAOYSA-N |
| Mol Weight | 312.37 g/mol |
| Molecular Formula | C18H20N2O3 |
| Exact Mass | 312.147393 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GThouauJOmL |
|---|---|
| Name | Ethanone, 1-(4-tert-butylphenyl)-2-[(3-nitrophenyl)amino]- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 312.147392509 u |
| Formula | C18H20N2O3 |
| InChI | InChI=1S/C18H20N2O3/c1-18(2,3)14-9-7-13(8-10-14)17(21)12-19-15-5-4-6-16(11-15)20(22)23/h4-11,19H,12H2,1-3H3 |
| InChIKey | GESRODRBJLFNSW-UHFFFAOYSA-N |
| SMILES | C1=CC=C(N(=O)=O)C=C1NCC(C=1C=CC(C(C)(C)C)=CC1)=O |